1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine

C167H369F3N28O6 — CID 158515112

IUPAC1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine
SMILESCC(C)(C)NCC1CNCCO1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CCN1CCC(CNC(C)(C)C)CC1.CCN1CCC(NC(C)(C)C)CC1.CCN1CCC(NC)CC1.CCN1CCCC(NC(C)(C)C)C1.CCN1CCCCC1COC(C)(C)C.CCN1CCOC(CNC(C)(C)C)C1.CN1CCCCC1COC(C)(C)C.COCCN1CCC(N)CC1.NC1CCCNC1.NC1CCN(C2COC2)CC1.NC1CCN(CC2CC2)CC1.NC1CCN(CCC(F)(F)F)CC1.NC1CCNCC1.NC1CN2CCC1CC2
InChIInChI=1S/C12H26N2.C12H25NO.C11H24N2O.2C11H24N2.C11H23NO.C9H20N2O.C9H18N2.C8H15F3N2.C8H16N2O.C8H18N2O.C8H18N2.C7H14N2.2C5H12N2.8C4H10/c1-5-14-8-6-11(7-9-14)10-13-12(2,3)4;1-5-13-9-7-6-8-11(13)10-14-12(2,3)4;1-5-13-6-7-14-10(9-13)8-12-11(2,3)4;1-5-13-8-6-10(7-9-13)12-11(2,3)4;1-5-13-8-6-7-10(9-13)12-11(2,3)4;1-11(2,3)13-9-10-7-5-6-8-12(10)4;1-9(2,3)11-7-8-6-10-4-5-12-8;10-9-3-5-11(6-4-9)7-8-1-2-8;9-8(10,11)3-6-13-4-1-7(12)2-5-13;9-7-1-3-10(4-2-7)8-5-11-6-8;1-11-7-6-10-4-2-8(9)3-5-10;1-3-10-6-4-8(9-2)5-7-10;8-7-5-9-3-1-6(7)2-4-9;6-5-1-3-7-4-2-5;6-5-2-1-3-7-4-5;8*1-4(2)3/h11,13H,5-10H2,1-4H3;11H,5-10H2,1-4H3;10,12H,5-9H2,1-4H3;2*10,12H,5-9H2,1-4H3;10H,5-9H2,1-4H3;8,10-11H,4-7H2,1-3H3;8-9H,1-7,10H2;7H,1-6,12H2;7-8H,1-6,9H2;8H,2-7,9H2,1H3;8-9H,3-7H2,1-2H3;6-7H,1-5,8H2;2*5,7H,1-4,6H2;8*4H,1-3H3
InChIKeyHLNMMEQMZYSOHE-UHFFFAOYSA-N
MW2922.97 g/mol
LogP27.71
Rot. Bonds27

About 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine

1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine (PubChem CID 158515112) has the molecular formula C167H369F3N28O6 and a molecular weight of 2922.97 g/mol. Its IUPAC name is 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine.

Molecular Properties

Compound Name1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine
PubChem CID158515112
Molecular FormulaC167H369F3N28O6
Molecular Weight2922.97 g/mol
Exact Mass2920.94
IUPAC Name1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine
SMILESCC(C)(C)NCC1CNCCO1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CCN1CCC(CNC(C)(C)C)CC1.CCN1CCC(NC(C)(C)C)CC1.CCN1CCC(NC)CC1.CCN1CCCC(NC(C)(C)C)C1.CCN1CCCCC1COC(C)(C)C.CCN1CCOC(CNC(C)(C)C)C1.CN1CCCCC1COC(C)(C)C.COCCN1CCC(N)CC1.NC1CCCNC1.NC1CCN(C2COC2)CC1.NC1CCN(CC2CC2)CC1.NC1CCN(CCC(F)(F)F)CC1.NC1CCNCC1.NC1CN2CCC1CC2
InChIInChI=1S/C12H26N2.C12H25NO.C11H24N2O.2C11H24N2.C11H23NO.C9H20N2O.C9H18N2.C8H15F3N2.C8H16N2O.C8H18N2O.C8H18N2.C7H14N2.2C5H12N2.8C4H10/c1-5-14-8-6-11(7-9-14)10-13-12(2,3)4;1-5-13-9-7-6-8-11(13)10-14-12(2,3)4;1-5-13-6-7-14-10(9-13)8-12-11(2,3)4;1-5-13-8-6-10(7-9-13)12-11(2,3)4;1-5-13-8-6-7-10(9-13)12-11(2,3)4;1-11(2,3)13-9-10-7-5-6-8-12(10)4;1-9(2,3)11-7-8-6-10-4-5-12-8;10-9-3-5-11(6-4-9)7-8-1-2-8;9-8(10,11)3-6-13-4-1-7(12)2-5-13;9-7-1-3-10(4-2-7)8-5-11-6-8;1-11-7-6-10-4-2-8(9)3-5-10;1-3-10-6-4-8(9-2)5-7-10;8-7-5-9-3-1-6(7)2-4-9;6-5-1-3-7-4-2-5;6-5-2-1-3-7-4-5;8*1-4(2)3/h11,13H,5-10H2,1-4H3;11H,5-10H2,1-4H3;10,12H,5-9H2,1-4H3;2*10,12H,5-9H2,1-4H3;10H,5-9H2,1-4H3;8,10-11H,4-7H2,1-3H3;8-9H,1-7,10H2;7H,1-6,12H2;7-8H,1-6,9H2;8H,2-7,9H2,1H3;8-9H,3-7H2,1-2H3;6-7H,1-5,8H2;2*5,7H,1-4,6H2;8*4H,1-3H3
InChIKeyHLNMMEQMZYSOHE-UHFFFAOYSA-N
XLogP27.71
TPSA384.67 Ų
H-Bond Donors16
H-Bond Acceptors34
Rotatable Bonds27
Heavy Atoms204
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002922.97
LogP ≤ 527.71
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1034

Analyze 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;N,N-dimethyl-1-morpholin-2-ylmethanamine;1-ethyl-N-methylpiperidin-4-amine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;4-methylpiperidin-4-ol;4-methyl-1-piperidin-4-ylpiperidin-4-ol;undecakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;2-(pyrrolidin-1-ylmethyl)morpholine;1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 158520390
N-tert-butyl-1-(cyclopropylmethyl)piperidin-4-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;N-tert-butyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine;1-ethyl-4-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(3-fluoropropyl)-4-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-(2-methoxyethyl)-4-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;2-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 158905092
N-tert-butyl-1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-(cyclopropylmethyl)piperidin-4-amine;1-tert-butyl-N,N-dimethylpiperidin-3-amine;N-tert-butyl-1-ethyl-N-methylpiperidin-4-amine;N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine;1-tert-butyl-4-methylpiperidin-4-ol;1-(4-tert-butylmorpholin-2-yl)-N,N-dimethylmethanamine;1-(4-tert-butylmorpholin-2-yl)-N-methylmethanamine;N-tert-butyl-1-(oxetan-3-yl)piperidin-4-amine;N-tert-butylpiperidin-4-amine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperidin-4-ol;4-tert-butyl-2-(pyrrolidin-1-ylmethyl)morpholine;N-tert-butyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 160095048
1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;N-tert-butyl-1-(2-methoxyethyl)piperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;N,N-dimethyl-1-morpholin-2-ylmethanamine;N,N-dimethylpiperidin-3-amine;1-ethyl-N-methylpiperidin-4-amine;N-methyl-1-morpholin-2-ylmethanamine;4-methylpiperidin-4-ol;4-methyl-1-piperidin-4-ylpiperidin-4-ol;tetradecakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;3-propylpiperidine;2-(pyrrolidin-1-ylmethyl)morpholine;1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 162260966
2,4-bis(2-methylpropyl)morpholine;4-tert-butyl-1-(2-methylpropyl)piperidine;1-(cyclopropylmethyl)-4-(2-methylpropyl)piperazine;2,2-diethyl-4-(2-methylpropyl)morpholine;2,2-dimethyl-4-(2-methylpropyl)morpholine;2,6-dimethyl-4-(2-methylpropyl)morpholine;N,N-dimethyl-1-(2-methylpropyl)piperidin-4-amine;4-(2-methoxypropan-2-yl)-1-(2-methylpropyl)piperidine;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-(oxan-4-yl)piperidine
CID 158081054

Frequently Asked Questions

What is the IUPAC name of 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The IUPAC name of 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine (CID 158515112) is 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine.
What is the SMILES notation for 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The canonical SMILES for 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine is CC(C)(C)NCC1CNCCO1.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CCN1CCC(CNC(C)(C)C)CC1.CCN1CCC(NC(C)(C)C)CC1.CCN1CCC(NC)CC1.CCN1CCCC(NC(C)(C)C)C1.CCN1CCCCC1COC(C)(C)C.CCN1CCOC(CNC(C)(C)C)C1.CN1CCCCC1COC(C)(C)C.COCCN1CCC(N)CC1.NC1CCCNC1.NC1CCN(C2COC2)CC1.NC1CCN(CC2CC2)CC1.NC1CCN(CCC(F)(F)F)CC1.NC1CCNCC1.NC1CN2CCC1CC2.
What is the InChIKey of 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The InChIKey is HLNMMEQMZYSOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2.C12H25NO.C11H24N2O.2C11H24N2.C11H23NO.C9H20N2O.C9H18N2.C8H15F3N2.C8H16N2O.C8H18N2O.C8H18N2.C7H14N2.2C5H12N2.8C4H10/c1-5-14-8-6-11(7-9-14)10-13-12(2,3)4;1-5-13-9-7-6-8-11(13)10-14-12(2,3)4;1-5-13-6-7-14-10(9-13)8-12-11(2,3)4;1-5-13-8-6-10(7-9-13)12-11(2,3)4;1-5-13-8-6-7-10(9-13)12-11(2,3)4;1-11(2,3)13-9-10-7-5-6-8-12(10)4;1-9(2,3)11-7-8-6-10-4-5-12-8;10-9-3-5-11(6-4-9)7-8-1-2-8;9-8(10,11)3-6-13-4-1-7(12)2-5-13;9-7-1-3-10(4-2-7)8-5-11-6-8;1-11-7-6-10-4-2-8(9)3-5-10;1-3-10-6-4-8(9-2)5-7-10;8-7-5-9-3-1-6(7)2-4-9;6-5-1-3-7-4-2-5;6-5-2-1-3-7-4-5;8*1-4(2)3/h11,13H,5-10H2,1-4H3;11H,5-10H2,1-4H3;10,12H,5-9H2,1-4H3;2*10,12H,5-9H2,1-4H3;10H,5-9H2,1-4H3;8,10-11H,4-7H2,1-3H3;8-9H,1-7,10H2;7H,1-6,12H2;7-8H,1-6,9H2;8H,2-7,9H2,1H3;8-9H,3-7H2,1-2H3;6-7H,1-5,8H2;2*5,7H,1-4,6H2;8*4H,1-3H3.
What are the key properties of 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine?
1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine has a molecular weight of 2922.97 g/mol, XLogP of 27.71, 27 rotatable bonds, 16 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azabicyclo[2.2.2]octan-3-amine;N-tert-butyl-1-ethylpiperidin-3-amine;N-tert-butyl-1-ethylpiperidin-4-amine;1-(cyclopropylmethyl)piperidin-4-amine;1-ethyl-N-methylpiperidin-4-amine;1-ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-[(4-ethylmorpholin-2-yl)methyl]-2-methylpropan-2-amine;N-[(1-ethylpiperidin-4-yl)methyl]-2-methylpropan-2-amine;1-(2-methoxyethyl)piperidin-4-amine;1-methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine;2-methyl-N-(morpholin-2-ylmethyl)propan-2-amine;octakis(2-methylpropane);1-(oxetan-3-yl)piperidin-4-amine;piperidin-3-amine;piperidin-4-amine;1-(3,3,3-trifluoropropyl)piperidin-4-amine is sourced from PubChem (CID 158515112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).